Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8951a872f5051efbdd5c74394b6f09a5",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 206.030,
"b": 57.614,
"c": 65.694,
"alpha": 90.000,
"beta": 107.185,
"gamma": 90.000
},
"wavelengths": [1.54184],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.256,2.939],
"number_observations_unique": 15930,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.141
},
{
"type": "R(meas)",
"value": 0.160
},
{
"type": "R(pim)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 7.9
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [3.04,2.939],
"number_observations_unique": 1551,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.63
},
{
"type": "R(meas)",
"value": 0.782
},
{
"type": "R(pim)",
"value": 0.454
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.686
}
]
}
]
}